10,10,15,15-tetramethyl-25-pyridin-4-yl-25-azaheptacyclo[14.11.0.02,14.03,11.04,9.018,26.019,24]heptacosa-1(16),2(14),3(11),4,6,8,12,17,19,21,23,26-dodecaene

C35H28N2 — CID 118301325

IUPAC10,10,15,15-tetramethyl-25-pyridin-4-yl-25-azaheptacyclo[14.11.0.02,14.03,11.04,9.018,26.019,24]heptacosa-1(16),2(14),3(11),4,6,8,12,17,19,21,23,26-dodecaene
SMILESCC1(C)c2ccccc2-c2c1ccc1c2-c2cc3c(cc2C1(C)C)c1ccccc1n3-c1ccncc1
InChIInChI=1S/C35H28N2/c1-34(2)26-11-7-5-10-23(26)32-27(34)13-14-28-33(32)25-20-31-24(19-29(25)35(28,3)4)22-9-6-8-12-30(22)37(31)21-15-17-36-18-16-21/h5-20H,1-4H3
InChIKeyKVQQBIGZKFKLRX-UHFFFAOYSA-N
MW476.62 g/mol
LogP8.79
Rot. Bonds1

About 10,10,15,15-tetramethyl-25-pyridin-4-yl-25-azaheptacyclo[14.11.0.02,14.03,11.04,9.018,26.019,24]heptacosa-1(16),2(14),3(11),4,6,8,12,17,19,21,23,26-dodecaene

10,10,15,15-tetramethyl-25-pyridin-4-yl-25-azaheptacyclo[14.11.0.02,14.03,11.04,9.018,26.019,24]heptacosa-1(16),2(14),3(11),4,6,8,12,17,19,21,23,26-dodecaene (PubChem CID 118301325) has the molecular formula C35H28N2 and a molecular weight of 476.62 g/mol. Its IUPAC name is 10,10,15,15-tetramethyl-25-pyridin-4-yl-25-azaheptacyclo[14.11.0.02,14.03,11.04,9.018,26.019,24]heptacosa-1(16),2(14),3(11),4,6,8,12,17,19,21,23,26-dodecaene.

Molecular Properties

Compound Name10,10,15,15-tetramethyl-25-pyridin-4-yl-25-azaheptacyclo[14.11.0.02,14.03,11.04,9.018,26.019,24]heptacosa-1(16),2(14),3(11),4,6,8,12,17,19,21,23,26-dodecaene
PubChem CID118301325
Molecular FormulaC35H28N2
Molecular Weight476.62 g/mol
Exact Mass476.23
IUPAC Name10,10,15,15-tetramethyl-25-pyridin-4-yl-25-azaheptacyclo[14.11.0.02,14.03,11.04,9.018,26.019,24]heptacosa-1(16),2(14),3(11),4,6,8,12,17,19,21,23,26-dodecaene
SMILESCC1(C)c2ccccc2-c2c1ccc1c2-c2cc3c(cc2C1(C)C)c1ccccc1n3-c1ccncc1
InChIInChI=1S/C35H28N2/c1-34(2)26-11-7-5-10-23(26)32-27(34)13-14-28-33(32)25-20-31-24(19-29(25)35(28,3)4)22-9-6-8-12-30(22)37(31)21-15-17-36-18-16-21/h5-20H,1-4H3
InChIKeyKVQQBIGZKFKLRX-UHFFFAOYSA-N
XLogP8.79
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500476.62
LogP ≤ 58.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 10,10,15,15-tetramethyl-25-pyridin-4-yl-25-azaheptacyclo[14.11.0.02,14.03,11.04,9.018,26.019,24]heptacosa-1(16),2(14),3(11),4,6,8,12,17,19,21,23,26-dodecaene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7,7-dimethyl-5-pyridin-4-ylindeno[2,1-b]carbazole
CID 66805075
11,11-dimethyl-5-phenylindeno[1,2-b]carbazole
CID 58059223
11,11-dimethyl-5-(4-phenylphenyl)indeno[1,2-b]carbazole
CID 58059239
5-(2,6-dibromo-4-pyridinyl)-11,11-dimethylindeno[1,2-b]carbazole
CID 86664282
11,11-dimethyl-5-triphenylen-2-ylindeno[1,2-b]carbazole
CID 118488496
11-[4-(9,9-dimethylfluoren-4-yl)phenyl]-5-phenylindolo[3,2-b]carbazole
CID 118487938
5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-11,11-dimethylindeno[1,2-b]carbazole
CID 58059235
9,9-dimethyl-16-(9-phenylcarbazol-3-yl)-16-azahexacyclo[11.11.0.02,10.03,8.015,23.017,22]tetracosa-1(24),2(10),3,5,7,11,13,15(23),17,19,21-undecaene
CID 126718190
15-[4-(11,11-dimethyl-25-phenyl-15,25-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.019,24]heptacosa-1(16),2,4(12),5,7,9,13,17,19,21,23,26-dodecaen-15-yl)phenyl]-11,11-dimethyl-25-phenyl-15,25-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.019,24]heptacosa-1(16),2,4(12),5,7,9,13,17,19,21,23,26-dodecaene
CID 89492388
20-[4-(9,9-dimethylfluoren-4-yl)phenyl]-20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1(25),2,4,6,8,10,12,14,16,18,21,23-dodecaene
CID 134580551
CID 134551753
CID 134551753
2-carbazol-9-yl-7,7-dimethyl-5-phenylindeno[2,1-b]carbazole
CID 139504500

Frequently Asked Questions

What is the IUPAC name of 10,10,15,15-tetramethyl-25-pyridin-4-yl-25-azaheptacyclo[14.11.0.02,14.03,11.04,9.018,26.019,24]heptacosa-1(16),2(14),3(11),4,6,8,12,17,19,21,23,26-dodecaene?
The IUPAC name of 10,10,15,15-tetramethyl-25-pyridin-4-yl-25-azaheptacyclo[14.11.0.02,14.03,11.04,9.018,26.019,24]heptacosa-1(16),2(14),3(11),4,6,8,12,17,19,21,23,26-dodecaene (CID 118301325) is 10,10,15,15-tetramethyl-25-pyridin-4-yl-25-azaheptacyclo[14.11.0.02,14.03,11.04,9.018,26.019,24]heptacosa-1(16),2(14),3(11),4,6,8,12,17,19,21,23,26-dodecaene.
What is the SMILES notation for 10,10,15,15-tetramethyl-25-pyridin-4-yl-25-azaheptacyclo[14.11.0.02,14.03,11.04,9.018,26.019,24]heptacosa-1(16),2(14),3(11),4,6,8,12,17,19,21,23,26-dodecaene?
The canonical SMILES for 10,10,15,15-tetramethyl-25-pyridin-4-yl-25-azaheptacyclo[14.11.0.02,14.03,11.04,9.018,26.019,24]heptacosa-1(16),2(14),3(11),4,6,8,12,17,19,21,23,26-dodecaene is CC1(C)c2ccccc2-c2c1ccc1c2-c2cc3c(cc2C1(C)C)c1ccccc1n3-c1ccncc1.
What is the InChIKey of 10,10,15,15-tetramethyl-25-pyridin-4-yl-25-azaheptacyclo[14.11.0.02,14.03,11.04,9.018,26.019,24]heptacosa-1(16),2(14),3(11),4,6,8,12,17,19,21,23,26-dodecaene?
The InChIKey is KVQQBIGZKFKLRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H28N2/c1-34(2)26-11-7-5-10-23(26)32-27(34)13-14-28-33(32)25-20-31-24(19-29(25)35(28,3)4)22-9-6-8-12-30(22)37(31)21-15-17-36-18-16-21/h5-20H,1-4H3.
What are the key properties of 10,10,15,15-tetramethyl-25-pyridin-4-yl-25-azaheptacyclo[14.11.0.02,14.03,11.04,9.018,26.019,24]heptacosa-1(16),2(14),3(11),4,6,8,12,17,19,21,23,26-dodecaene?
10,10,15,15-tetramethyl-25-pyridin-4-yl-25-azaheptacyclo[14.11.0.02,14.03,11.04,9.018,26.019,24]heptacosa-1(16),2(14),3(11),4,6,8,12,17,19,21,23,26-dodecaene has a molecular weight of 476.62 g/mol, XLogP of 8.79, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10,10,15,15-tetramethyl-25-pyridin-4-yl-25-azaheptacyclo[14.11.0.02,14.03,11.04,9.018,26.019,24]heptacosa-1(16),2(14),3(11),4,6,8,12,17,19,21,23,26-dodecaene is sourced from PubChem (CID 118301325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).